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SMILES: CN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)c1cc(nc2ccccc12)-c1ccncc1

InChI Key: InChIKey=HTMRXYAUTQYKLC-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 89177   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
High affinity choline transporter 1


(Homo sapiens (Human))		BDBM89177
PNG
(MLS001140154 | N-[2-keto-2-(2,3,4-trifluoroanilino...)
Show SMILES CN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)c1cc(nc2ccccc12)-c1ccncc1
Show InChI InChI=1S/C24H17F3N4O2/c1-31(13-21(32)30-19-7-6-17(25)22(26)23(19)27)24(33)16-12-20(14-8-10-28-11-9-14)29-18-5-3-2-4-15(16)18/h2-12H,13H2,1H3,(H,30,32)
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PC cid
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n/an/an/an/a 1.46E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
Data Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center Affiliation: Johns Hopkins University, School of Medicine Screening ...

PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q21N7ZQ4
More data for this
Ligand-Target Pair